BDBM652705 6-N-({2-[3-(1-methylimidazol-2-yl)propoxy]pyridin-4-yl}methyl)isoquinoline-1,6-diamine::US20240059691, Example 4420

SMILES Cn1ccnc1CCCOc1cc(CNc2ccc3c(N)nccc3c2)ccn1

InChI Key InChIKey=POKGXFZJGCGYEF-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 652705   

TargetCoagulation factor XII(Human)
Kalvista Pharmaceuticals

US Patent
LigandChemical structure of BindingDB Monomer ID 652705BDBM652705(US20240059691, Example 4420 | 6-N-({2-[3-(1-methyl...)
Affinity DataIC50: 2.00E+3nMAssay Description:In vitro inhibition of Factor XIIa was determined using an IC50 assay based on standard literature methods (see e.g Baeriswyl et al., ACS Chem. Biol....More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/24/2024
Entry Details
US Patent